Pregna-4,6-diene-3,20-dione, 17-hydroxy-16-methylene-, hexanoate

CAS Registry Number®

6723-94-0

CAS Name

Pregna-4,6-diene-3,20-dione, 17-hydroxy-16-methylene-, hexanoate

Molecular Formula

C28H38O4

Molecular Mass

438.60

Cite this Page

Pregna-4,6-diene-3,20-dione, 17-hydroxy-16-methylene-, hexanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6723-94-0 (retrieved 2024-11-22) (CAS RN: 6723-94-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    143-144 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C28H38O4/c1-6-7-8-9-25(31)32-28(19(3)29)18(2)16-24-22-11-10-20-17-21(30)12-14-26(20,4)23(22)13-15-27(24,28)5/h10-11,17,22-24H,2,6-9,12-16H2,1,3-5H3/t22-,23+,24+,26+,27+,28+/m1/s1

InChIKey

InChIKey=WQBCIYORLVRAQX-BDPSOKNUSA-N

SMILES

C[C@@]12[C@@](OC(CCCCC)=O)(C(C)=O)C(=C)C[C@]1([C@]3([C@](CC2)([C@]4(C)C(C=C3)=CC(=O)CC4)[H])[H])[H]

Canonical SMILES

O=C(OC1(C(=O)C)C(=C)CC2C3C=CC4=CC(=O)CCC4(C)C3CCC21C)CCCCC

Other Names for this Substance

  • Pregna-4,6-diene-3,20-dione, 17-hydroxy-16-methylene-, hexanoate
  • Hexanoic acid, ester with 17-hydroxy-16-methylpregna-4,6-diene-3,20-dione

CAS INSIGHTSTM
Targeted protein degrader structure, illustration